Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 6/20 | 0.75 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.75 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.75 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | NPC1 | O15118 | 3/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.65 |
| ▸ | MMP2 | P08253 | 9/20 | 0.63 |
| ▸ | MMP3 | P08254 | 7/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | MMP13 | P45452 | 3/20 | 0.55 |
| ▸ | MMP1 | P03956 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6774277 | 0.82 | ALDH1A1 (0.60) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL7207785 | 0.80 | PDE4A (0.77) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL29160472 | 0.79 | ALDH1A1 (0.90) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL6823156 | 0.78 | MMP2 (1.00) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL5702949 | 0.76 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL15617705 | 0.76 | NPC1 (0.69) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL22362036 | 0.75 | KMT2A (0.56) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL6774272 | 0.75 | PDE4A (0.53) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL7407018 | 0.74 | MMP13 (0.72) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL11888564 | 0.74 | PDE4A (0.65) | PDE4APDE4BPDE4CPDE4DALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6133409-A | REACTING A SOLID SUPPORT-BOUND N-ALKYLATED HYDROXAMIC ACID WITH A CARBON-NITROGEN CLEAVING ORGANOMETALLIC COMPUND TO LIBERATE THE PRODUCT KETONE | AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) | 2000-10-17 | — | — | US | disclosed |